| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID40181185 |
Structure
| InChI Key | OSVAWQJNBLOEMP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H5Cl2N3O1 |
| Molecular Weight | 204.98 |
| AlogP | 1.74 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 47.9 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26650-76-0 |
| NORMAN SUSDAT | |
| PubChem | 33571 |
| ChemSpider | 30970.0 |
CONTENTS
